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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Thrombin' and Monomerid = 50110018   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50110018
PNG
(2-Amino-N-[(4-carbamimidoyl-benzylcarbamoyl)-methy...)
Show SMILES N[C@H](CO)C(=O)NCC(=O)NCc1ccc(cc1)C(N)=N
Show InChI InChI=1S/C13H19N5O3/c14-10(7-19)13(21)18-6-11(20)17-5-8-1-3-9(4-2-8)12(15)16/h1-4,10,19H,5-7,14H2,(H3,15,16)(H,17,20)(H,18,21)/t10-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.00E+5n/an/an/an/an/an/an/an/a



Universitat Jena

Curated by ChEMBL


Assay Description
In vitro inhibition of thrombin.


Bioorg Med Chem Lett 12: 645-8 (2002)


Article DOI: 10.1016/s0960-894x(01)00815-0
BindingDB Entry DOI: 10.7270/Q2NZ86XS
More data for this
Ligand-Target Pair